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trans-5-(N-Allyl-N-tosylamino)-6-allyl-4-(phenylthio)-5,6-dihydropyran-2-one
SpectraBase Compound ID 5bKFBxiEHzl
InChI InChI=1S/C24H25NO4S2/c1-4-9-21-24(22(17-23(26)29-21)30-19-10-7-6-8-11-19)25(16-5-2)31(27,28)20-14-12-18(3)13-15-20/h4-8,10-15,17,21,24H,1-2,9,16H2,3H3/t21-,24-/m0/s1
InChIKey LAVOOKFPURZWMP-URXFXBBRSA-N
Mol Weight 455.59 g/mol
Molecular Formula C24H25NO4S2
Exact Mass 455.122501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ZxQVrlXuic
Name trans-5-(N-Allyl-N-tosylamino)-6-allyl-4-(phenylthio)-5,6-dihydropyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H25NO4S2
InChI InChI=1S/C24H25NO4S2/c1-4-9-21-24(22(17-23(26)29-21)30-19-10-7-6-8-11-19)25(16-5-2)31(27,28)20-14-12-18(3)13-15-20/h4-8,10-15,17,21,24H,1-2,9,16H2,3H3/t21-,24-/m0/s1
InChIKey LAVOOKFPURZWMP-URXFXBBRSA-N
Molecular Weight 455.587 g/mol
SMILES [C@]1(N(S(c2ccc(cc2)C)(=O)=O)CC=C)(C(=CC(O[C@]1(CC=C)[H])=O)Sc1ccccc1)[H]
SPLASH splash10-001l-9140000000-848a6b344488f9270090
Source of Spectrum J-70-1853-16
Synonyms N-allyl-N-((2S,3S)-2-allyl-6-oxo-4-(phenylthio)-3,6-dihydro-2H-pyran-3-yl)-4-methylbenzenesulfonamide
Wiley ID 1742663